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CHEBI:135671 - sancycline

Default Structure
ChEBI IDCHEBI:135671
ChEBI Namesancycline
Stars
Last Modified23 February 2017
DownloadsMolfile
FormulaC21H22N2O7
Net Charge0
Average Mass414.414
Monoisotopic Mass414.14270
SMILES[H][C@@]12Cc3cccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2
InChIInChI=1S/C21H22N2O7/c1-23(2)15-10-7-9-6-8-4-3-5-11(24)12(8)16(25)13(9)18(27)21(10,30)19(28)14(17(15)26)20(22)29/h3-5,9-10,15,24,26-27,30H,6-7H2,1-2H3,(H2,22,29)/t9-,10-,15-,21-/m0/s1
InChIKeyXDVCLKFLRAWGIT-ADOAZJKMSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
sancycline (CHEBI:135671) is a tetracyclines (CHEBI:26895)
Synonyms  Source
bonomycinDrugCentral
norcyclineDrugCentral
Manual XrefsDatabases
3828DrugCentral
Registry NumbersSources
CAS:808-26-4DrugCentral